SCHEMBL9408339

SCHEMBL9408339

CC(Oc1ccc(C(C)c2ccccc2)cc1C(=O)O)c1ccccc1.[Zn]

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 7/20 0.52
LTB4R2 Q9NPC1 7/20 0.52
RORC P51449 2/20 0.47
LRRK2 Q5S007 1/20 0.46
ALOX5 P09917 1/20 0.40
FFAR1 O14842 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
ALKBH1 Q13686 1/20 0.38
BRD4 O60885 4/20 0.38
MEN1 O00255 1/20 0.37
GFER P55789 1/20 0.37
KMT2A Q03164 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL312341 0.99 LTB4R (0.53) LTB4RLTB4R2RORCLRRK2ALOX5
SCHEMBL8373824 0.89 LTB4R (0.44) LTB4RLTB4R2RORCLRRK2ALDH1A1
SCHEMBL5710470 0.87 KDM4E (0.49) LTB4RLTB4R2RORCALOX5FFAR1
SCHEMBL8425437 0.85 LTB4R (0.44) LTB4RLTB4R2RORCLRRK2KDM4E
SCHEMBL9810575 0.84 ALDH1A1 (0.53) KDM4EALDH1A1HPGDMEN1GFER
SCHEMBL9651898 0.83 KDM4E (0.45) LTB4RLTB4R2RORCLRRK2KDM4E
SCHEMBL10591294 0.82 LTB4R (0.54) LTB4RLTB4R2RORCLRRK2FFAR1
SCHEMBL6376403 0.82 KDM4E (0.41) LTB4RLTB4R2RORCKDM4EALDH1A1
SCHEMBL10408836 0.82 KDM4E (0.53) LTB4RLTB4R2RORCFFAR1KDM4E
SCHEMBL10698079 0.81 LTB4R (0.53) LTB4RLTB4R2RORCLRRK2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6297834-A None JP disclosed
JP-H06297834-A PRESSURE-SENSITIVE RECORDING SHEET NEW OJI PAPER CO LTD 1994-10-25 JP disclosed